REMARK ROI 2D Peak Detection System, File: ./test.ft2 REMARK Detection Levels: -1.14597e+08 and 114596 REMARK Detection: X(+/-1) Y(+/-1) REMARK Interpolation: X(+/-1) Y(+/-1) REMARK Noise: 6606.1, Chi2-Threshold: 1.000000e-04, Local Adjustment: None REMARK Position Tolerances: X(2.0) Y(2.0) REMARK Sinc Detect ON, Height Adjustments: X(1.800) Y(1.200) REMARK Sinc Detect Linewidths: X(5.0Hz) Y(15.0Hz) REMARK Total Peaks: 70, Good Peaks: 70, Questionable Peaks: 0 REMARK Clusters: 37, Max Cluster Size: 13 REMARK ROI Spectral Axis Limits: DATA X_AXIS 1H 1 105 5.458ppm 3.045ppm DATA Y_AXIS 1H 1 424 5.501ppm 3.019ppm VARS INDEX X_AXIS Y_AXIS DX DY X_PPM Y_PPM X_HZ Y_HZ XW YW XW_HZ YW_HZ X1 X3 Y1 Y3 HEIGHT DHEIGHT VOL PCHI2 TYPE ASS CLUSTID MEMCNT FORMAT %5d %9.3f %9.3f %6.3f %6.3f %8.3f %8.3f %9.3f %9.3f %7.3f %7.3f %8.3f %8.3f %4d %4d %4d %4d %+e %+e %+e %.5f %d %s %4d %4d 1 10.182 46.161 0.006 0.008 5.245 5.236 2098.611 2095.081 2.250 3.547 20.893 8.327 8 11 44 49 2.660362e+06 5.233415e+03 1.879370e+07 0.00000 1 None 1 1 2 75.970 46.269 0.051 0.059 3.718 5.235 1487.813 2094.825 2.638 3.358 24.492 7.882 75 77 45 48 3.946459e+05 5.149512e+03 2.757532e+06 0.00000 1 None 2 1 3 82.281 46.217 0.043 0.042 3.572 5.236 1429.226 2094.948 2.509 3.491 23.295 8.194 81 84 44 48 5.753225e+05 5.267500e+03 4.690418e+06 0.00000 1 None 3 1 4 29.056 120.417 0.000 0.000 4.807 4.800 1923.381 1920.764 2.227 3.101 20.676 7.280 27 30 118 122 6.460698e+07 5.434137e+03 3.989145e+08 0.00000 1 None 4 2 5 71.090 119.551 0.023 0.058 3.832 4.805 1533.119 1922.797 1.774 3.015 16.470 7.077 71 72 118 121 5.028525e+05 6.149020e+03 1.761302e+06 0.00000 1 None 5 1 6 15.436 120.873 0.148 0.016 5.123 4.798 2049.836 1919.693 4.012 2.288 37.247 5.372 14 18 120 122 5.588092e+05 5.267830e+03 5.194924e+06 0.00000 1 None 4 2 7 36.118 146.805 0.015 0.011 4.643 4.646 1857.815 1858.816 2.425 2.705 22.511 6.351 35 37 145 149 1.225759e+06 5.322658e+03 8.011960e+06 0.00000 1 None 6 2 8 75.801 146.883 0.033 0.016 3.722 4.645 1489.384 1858.634 2.523 2.530 23.428 5.940 74 77 146 149 6.777872e+05 5.322923e+03 4.290810e+06 0.00000 1 None 7 2 9 85.182 146.855 0.013 0.007 3.505 4.645 1402.290 1858.700 2.573 2.594 23.890 6.089 83 87 145 149 1.707625e+06 5.304467e+03 1.221742e+07 0.00000 1 None 8 2 10 94.860 146.909 0.039 0.017 3.280 4.645 1312.439 1858.572 2.753 2.517 25.561 5.908 93 96 146 149 6.112119e+05 5.240822e+03 4.218678e+06 0.00000 1 None 9 2 11 36.141 150.082 0.015 0.009 4.642 4.626 1857.605 1851.124 2.463 2.577 22.865 6.049 35 37 148 152 1.284689e+06 5.356371e+03 7.836866e+06 0.00000 1 None 6 2 12 75.808 150.207 0.032 0.019 3.722 4.626 1489.316 1850.830 2.505 2.620 23.254 6.151 75 77 148 151 7.075948e+05 5.440705e+03 4.184348e+06 0.00000 1 None 7 2 13 85.209 150.130 0.013 0.006 3.504 4.626 1402.039 1851.011 2.588 2.570 24.029 6.033 84 87 148 152 1.839528e+06 5.375153e+03 1.275959e+07 0.00000 1 None 8 2 14 94.878 150.197 0.035 0.021 3.280 4.626 1312.269 1850.854 2.634 2.646 24.458 6.211 94 96 148 151 6.295069e+05 5.343986e+03 4.001068e+06 0.00000 1 None 9 2 15 60.361 241.563 0.077 0.044 4.081 4.090 1632.738 1636.373 2.710 2.676 25.164 6.282 59 62 240 243 4.773448e+05 5.614647e+03 2.958385e+06 0.00000 1 None 10 1 16 76.081 241.844 0.091 0.035 3.716 4.088 1486.785 1635.712 2.930 2.372 27.206 5.567 75 77 241 243 2.812095e+05 5.207329e+03 1.452783e+06 0.00000 1 None 11 1 17 82.312 241.596 0.031 0.017 3.571 4.089 1428.931 1636.294 2.714 2.625 25.200 6.163 81 84 240 244 1.089872e+06 5.542370e+03 7.529594e+06 0.00000 1 None 12 4 18 85.814 241.725 0.064 0.027 3.490 4.089 1396.417 1635.992 2.924 2.463 27.147 5.781 84 87 241 243 4.706055e+05 5.303590e+03 3.373730e+06 0.00000 1 None 12 4 19 60.367 245.859 0.066 0.021 4.080 4.064 1632.675 1626.288 2.805 2.509 26.043 5.891 59 62 245 247 5.534579e+05 5.422721e+03 3.125217e+06 0.00000 1 None 13 1 20 76.080 246.016 0.072 0.026 3.716 4.063 1486.798 1625.917 2.857 2.368 26.528 5.559 75 77 245 247 3.350423e+05 5.213870e+03 1.705812e+06 0.00000 1 None 14 1 21 82.346 245.890 0.028 0.009 3.570 4.064 1428.615 1626.215 2.796 2.454 25.957 5.761 81 84 244 247 1.233899e+06 5.394213e+03 7.653704e+06 0.00000 1 None 12 4 22 85.806 245.975 0.056 0.017 3.490 4.064 1396.491 1626.014 2.924 2.381 27.145 5.589 84 87 245 247 5.224488e+05 5.232643e+03 3.766895e+06 0.00000 1 None 12 4 23 85.185 302.152 0.016 0.018 3.504 3.734 1402.258 1494.140 2.559 3.735 23.755 8.768 83 87 300 305 1.362532e+06 5.250473e+03 1.982795e+07 0.00000 1 None 15 4 24 94.894 302.827 0.032 0.070 3.279 3.730 1312.121 1492.555 2.434 4.667 22.596 10.955 94 96 301 306 5.352939e+05 5.018540e+03 6.347178e+06 0.00000 1 None 16 2 25 10.182 304.211 0.081 0.056 5.245 3.722 2098.608 1489.305 1.973 2.184 18.316 5.127 10 10 304 305 1.911391e+05 6.098887e+03 3.052002e+05 0.00000 1 None 17 1 26 60.442 304.482 0.174 0.096 4.079 3.720 1631.983 1488.669 2.659 2.644 24.684 6.206 60 61 304 305 2.419621e+05 5.864312e+03 8.312372e+05 0.00000 1 None 18 1 27 82.588 304.496 0.114 0.055 3.565 3.720 1426.370 1488.635 2.931 2.897 27.213 6.800 81 85 303 306 5.602195e+05 6.112166e+03 1.187330e+07 0.00000 1 None 15 4 28 36.173 304.718 0.024 0.033 4.642 3.719 1857.302 1488.115 2.349 3.398 21.806 7.977 35 37 303 307 7.630502e+05 5.255137e+03 5.341307e+06 0.00000 1 None 19 1 29 75.833 305.049 0.013 0.021 3.722 3.717 1489.090 1487.339 2.397 4.393 22.257 10.312 74 77 302 308 1.391543e+06 5.090045e+03 1.651376e+07 0.00000 1 None 20 1 30 85.316 305.321 0.019 0.021 3.501 3.716 1401.046 1486.700 2.789 3.883 25.891 9.114 83 87 302 308 1.697532e+06 5.188714e+03 2.529635e+07 0.00000 1 None 15 4 31 94.918 305.631 0.036 0.046 3.279 3.714 1311.900 1485.972 2.587 3.261 24.015 7.655 93 96 304 307 5.616831e+05 5.232842e+03 4.623658e+06 0.00000 1 None 16 2 32 10.216 308.332 0.135 0.093 5.244 3.698 2098.297 1479.632 2.098 2.201 19.480 5.166 10 10 308 308 1.447842e+05 6.321924e+03 1.356573e+05 0.00000 1 None 21 1 33 60.509 308.418 0.227 0.105 4.077 3.697 1631.358 1479.430 2.754 2.676 25.568 6.282 60 61 308 309 2.105079e+05 5.807938e+03 7.261881e+05 0.00000 1 None 22 1 34 82.472 308.422 0.135 0.092 3.567 3.697 1427.450 1479.420 2.923 3.346 27.135 7.855 81 84 306 310 3.739997e+05 5.738612e+03 5.203798e+06 0.00000 1 None 15 4 35 10.200 328.177 0.065 0.102 5.244 3.581 2098.441 1433.044 2.081 3.575 19.321 8.393 10 11 327 330 2.344722e+05 5.311502e+03 1.199271e+06 0.00000 1 None 23 1 36 60.308 328.425 0.043 0.052 4.082 3.580 1633.230 1432.464 2.536 3.447 23.548 8.092 59 62 327 330 6.502174e+05 5.398213e+03 4.990630e+06 0.00000 1 None 24 2 37 75.895 328.459 0.066 0.102 3.720 3.580 1488.508 1432.383 2.572 3.395 23.879 7.970 75 77 327 330 3.205518e+05 5.311115e+03 2.254921e+06 0.00000 1 None 25 13 38 82.292 328.477 0.044 0.062 3.572 3.580 1429.119 1432.341 2.492 3.488 23.133 8.188 81 84 327 330 6.030062e+05 5.424871e+03 4.817256e+06 0.00000 1 None 25 13 39 85.837 328.668 0.133 0.132 3.489 3.579 1396.209 1431.893 2.682 3.208 24.901 7.530 84 86 328 329 1.791810e+05 5.183974e+03 9.850712e+05 0.00000 1 None 25 13 40 10.218 332.487 0.092 0.276 5.244 3.556 2098.275 1422.929 2.011 3.762 18.669 8.832 10 10 332 333 1.669421e+05 5.479893e+03 3.142378e+05 0.00000 1 None 26 1 41 60.362 332.630 0.062 0.059 4.080 3.555 1632.728 1422.591 2.624 3.413 24.362 8.012 59 62 331 334 5.146788e+05 5.395966e+03 4.097478e+06 0.00000 1 None 24 2 42 75.978 332.951 0.095 0.093 3.718 3.553 1487.745 1421.838 2.690 3.597 24.976 8.443 75 77 330 336 2.103816e+05 5.032361e+03 2.923555e+06 0.00000 1 None 25 13 43 82.342 332.597 0.063 0.067 3.570 3.556 1428.653 1422.669 2.579 3.422 23.947 8.034 81 84 331 334 4.810328e+05 5.415298e+03 3.911842e+06 0.00000 1 None 25 13 44 36.074 335.427 0.105 0.120 4.644 3.539 1858.224 1416.026 2.315 2.701 21.497 6.341 36 36 335 336 1.698229e+05 5.559044e+03 3.107375e+05 0.00000 1 None 27 1 45 75.758 335.986 0.100 0.073 3.723 3.536 1489.781 1414.713 2.516 3.270 23.356 7.677 75 76 334 338 2.326888e+05 5.260149e+03 2.311378e+06 0.00000 1 None 25 13 46 84.902 336.179 0.067 0.062 3.511 3.534 1404.888 1414.260 2.521 3.148 23.403 7.389 84 86 335 338 2.880592e+05 5.231168e+03 3.486290e+06 0.00000 1 None 25 13 47 36.137 340.121 0.009 0.013 4.643 3.511 1857.639 1405.007 2.320 3.823 21.543 8.976 34 37 338 343 1.849507e+06 5.123496e+03 1.988572e+07 0.00000 1 None 28 3 48 60.295 340.085 0.112 0.037 4.082 3.512 1633.343 1405.091 2.590 2.329 24.048 5.468 60 61 339 341 2.498639e+05 5.446380e+03 9.457012e+05 0.00000 1 None 29 1 49 75.798 339.920 0.011 0.007 3.722 3.513 1489.411 1405.479 2.538 3.085 23.560 7.243 74 78 338 342 2.049939e+06 5.181102e+03 1.707221e+07 0.00000 1 None 25 13 50 85.137 340.078 0.006 0.006 3.506 3.512 1402.710 1405.106 2.453 3.518 22.774 8.258 83 87 338 342 3.163619e+06 5.106058e+03 2.900315e+07 0.00000 1 None 25 13 51 94.851 339.903 0.044 0.031 3.280 3.513 1312.517 1405.519 2.565 3.016 23.811 7.080 94 96 338 342 4.729189e+05 5.164816e+03 3.551242e+06 0.00000 1 None 30 2 52 36.162 342.794 0.010 0.013 4.642 3.496 1857.406 1398.731 2.356 3.536 21.871 8.300 34 37 340 346 1.891244e+06 5.206223e+03 2.012157e+07 0.00000 1 None 28 3 53 85.162 343.015 0.006 0.006 3.505 3.494 1402.478 1398.213 2.485 3.643 23.072 8.552 83 87 340 346 3.254302e+06 5.162656e+03 4.071365e+07 0.00000 1 None 25 13 54 94.869 343.472 0.044 0.082 3.280 3.492 1312.352 1397.141 2.515 3.645 23.350 8.558 94 96 340 345 4.768044e+05 5.365505e+03 5.057293e+06 0.00000 1 None 30 2 55 60.352 344.168 0.066 0.022 4.081 3.488 1632.814 1395.506 2.688 2.435 24.960 5.715 59 61 343 345 5.079983e+05 5.482630e+03 2.429189e+06 0.00000 1 None 31 1 56 75.848 343.564 0.010 0.012 3.721 3.491 1488.944 1396.925 2.523 3.126 23.421 7.338 74 78 342 346 2.215500e+06 5.348228e+03 1.762304e+07 0.00000 1 None 25 13 57 36.225 346.600 0.088 0.082 4.641 3.473 1856.822 1389.797 2.427 2.814 22.530 6.605 36 37 345 347 2.620992e+05 5.501230e+03 1.639051e+06 0.00000 1 None 28 3 58 85.339 347.305 0.062 0.070 3.501 3.469 1400.827 1388.141 2.672 3.897 24.810 9.147 84 87 344 349 5.131317e+05 5.407194e+03 1.361520e+07 0.00000 1 None 25 13 59 60.315 348.161 0.130 0.046 4.082 3.464 1633.165 1386.132 2.729 2.467 25.336 5.792 60 61 347 349 2.480030e+05 5.426636e+03 9.915482e+05 0.00000 1 None 32 1 60 75.894 347.999 0.043 0.022 3.720 3.465 1488.524 1386.512 2.691 2.734 24.988 6.417 74 77 346 349 5.106563e+05 5.166553e+03 3.809022e+06 0.00000 1 None 25 13 61 82.206 348.388 0.187 0.112 3.574 3.463 1429.917 1385.599 2.634 2.479 24.454 5.819 82 82 348 349 1.484204e+05 5.697789e+03 2.617520e+05 0.00000 1 None 33 1 62 36.119 376.955 0.030 0.050 4.643 3.295 1857.809 1318.537 2.311 4.188 21.455 9.831 35 37 375 380 5.365733e+05 5.066772e+03 6.892230e+06 0.00000 1 None 34 3 63 85.185 377.186 0.049 0.083 3.504 3.294 1402.257 1317.997 2.392 4.217 22.212 9.898 84 86 375 380 3.853560e+05 5.079250e+03 4.883704e+06 0.00000 1 None 35 2 64 94.901 376.992 0.032 0.083 3.279 3.295 1312.059 1318.452 2.465 5.540 22.882 13.005 94 96 375 381 5.467687e+05 4.969224e+03 1.010584e+07 0.00000 1 None 36 3 65 36.121 379.986 0.020 0.018 4.643 3.277 1857.789 1311.423 2.365 3.173 21.960 7.448 35 37 378 382 8.793046e+05 5.207239e+03 6.495520e+06 0.00000 1 None 34 3 66 75.759 379.894 0.024 0.023 3.723 3.278 1489.779 1311.639 2.439 3.601 22.646 8.453 74 77 377 383 9.227174e+05 5.205473e+03 1.074724e+07 0.00000 1 None 37 1 67 85.251 380.060 0.042 0.035 3.503 3.277 1401.645 1311.250 2.552 3.562 23.694 8.361 84 87 377 383 5.673337e+05 5.162170e+03 6.925868e+06 0.00000 1 None 35 2 68 94.935 379.939 0.018 0.015 3.278 3.278 1311.736 1311.533 2.576 3.152 23.918 7.399 93 97 378 382 1.049549e+06 5.134606e+03 9.411702e+06 0.00000 1 None 36 3 69 36.191 382.760 0.045 0.128 4.641 3.261 1857.138 1304.912 2.311 5.068 21.454 11.898 35 37 379 385 3.982616e+05 5.125770e+03 7.383080e+06 0.00000 1 None 34 3 70 94.958 382.838 0.034 0.061 3.278 3.261 1311.524 1304.729 2.524 4.356 23.430 10.227 94 96 380 385 5.291623e+05 5.066268e+03 7.870812e+06 0.00000 1 None 36 3